SCHEMBL10403866

SCHEMBL10403866

CCN1CCN(C(=O)NC(C=S)C(C)O)C(=O)C1=O

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10403348 0.88 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL9328985 0.88 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL13953294 0.82 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL14849507 0.81 GAA (0.40) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL10403864 0.80 GAA (0.37) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL14866125 0.80 GAA (0.47) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL18634217 0.80 GAA (0.39) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL11363578 0.78 GAA (0.38) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL3737134 0.78 GAA (0.38) GAAL3MBTL1POLBSMN1; SMN2
SCHEMBL9686944 0.78 GAA (0.38) GAAL3MBTL1POLBSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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